REMARK  Name = BDB028478
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.581  -0.744   0.097  0.00  0.00    +0.138 C 
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1       -4.706   0.529  -0.167  0.00  0.00    +0.110 C 
ATOM      3  C   LIG    1       -3.945   1.039   1.072  0.00  0.00    +0.123 C 
ATOM      4  N   LIG    1       -2.721   0.787   0.327  0.00  0.00    -0.284 N 
ATOM      5  C   LIG    1       -1.600   0.143   0.770  0.00  0.00    +0.302 C 
ATOM      6  N   LIG    1       -0.726  -0.186  -0.240  0.00  0.00    -0.297 N 
ATOM      7  H   LIG    1       -0.746   0.485  -0.997  0.00  0.00    +0.150 HD
ATOM      8  O   LIG    1       -1.396  -0.117   1.950  0.00  0.00    -0.253 OA
ATOM      9  C   LIG    1       -3.399   0.752  -0.959  0.00  0.00    +0.123 C 
BRANCH   2  12
ATOM     10  C   LIG    1       -7.341   0.043   1.044  0.00  0.00    +0.131 C 
ATOM     11  N   LIG    1       -7.150   1.104   0.068  0.00  0.00    -0.307 N 
ATOM     12  C   LIG    1       -5.948   1.327  -0.615  0.00  0.00    +0.221 C 
ATOM     13  O   LIG    1       -5.894   2.131  -1.556  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -8.362   1.730  -0.438  0.00  0.00    +0.131 C 
ENDBRANCH   2  12
ENDBRANCH   1   6
BRANCH   1  15
ATOM     15  C   LIG    1        1.239  -1.369  -1.136  0.00  0.00    +0.146 C 
BRANCH  15  16
ATOM     16  O   LIG    1        0.306  -2.289  -1.737  0.00  0.00    -0.389 OA
ATOM     17  H   LIG    1       -0.586  -1.959  -1.516  0.00  0.00    +0.210 HD
ENDBRANCH  15  16
BRANCH  15  18
ATOM     18  C   LIG    1        2.541  -2.147  -0.838  0.00  0.00    +0.117 C 
BRANCH  18  19
ATOM     19  N   LIG    1        3.726  -1.463  -0.312  0.00  0.00    -0.295 NA
ATOM     20  C   LIG    1        4.090  -0.244  -1.041  0.00  0.00    +0.120 C 
ATOM     21  C   LIG    1        5.335   0.431  -0.502  0.00  0.00    -0.030 A 
ATOM     22  C   LIG    1        5.815   0.143   0.788  0.00  0.00    -0.042 A 
ATOM     23  C   LIG    1        6.952   0.804   1.272  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1        7.593   1.766   0.492  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        7.109   2.068  -0.778  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        5.149  -0.926   1.619  0.00  0.00    +0.051 C 
ATOM     27  C   LIG    1        5.984   1.407  -1.273  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1        3.727  -1.247   1.135  0.00  0.00    +0.089 C 
ENDBRANCH  18  19
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 6